SCHEMBL6675696

SCHEMBL6675696

Cc1ccc(-c2ccc(CNC(=O)Oc3cc(NC(=O)c4ccccc4-c4ccc(F)cc4)cn3C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
PPARG P37231 3/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
MTTP P55157 2/20 0.40
HTT P42858 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 2/20 0.39
RECQL P46063 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
MCHR1 Q99705 1/20 0.39
TP53 P04637 1/20 0.39
KMT2A Q03164 1/20 0.38
AKR1C4 P17516 1/20 0.38
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6675775 0.96 CHRNB2 (0.44) LMNAPPARGCHRNB2CHRNB4CHRNA3
SCHEMBL6680330 0.91 MTTP (0.49) PPARGMTTP
SCHEMBL7041084 0.86 LMNA (0.46) LMNAPPARGCHRNB2CHRNB4CHRNA3
SCHEMBL7252437 0.84 HPGD (0.46) HTTL3MBTL1ALDH1A1TP53KMT2A
SCHEMBL6674719 0.84 MTTP (0.49) PPARGMTTP
SCHEMBL7252308 0.83 ALDH1A1 (0.58) LMNAHTTL3MBTL1ALDH1A1TP53
SCHEMBL6675663 0.83 MTTP (0.49) PPARGMTTP
SCHEMBL7253319 0.83 MTTP (0.50) PPARGMTTP
SCHEMBL7252903 0.83 MTTP (0.50) PPARGMTTP
SCHEMBL7256228 0.82 MTTP (0.49) PPARGMTTP

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465613-A2 COMBINATION OF MTP INHIBITORS OR APOB SECRETION INHIBITORS WITH FIBRATES FOR USE AS DRUGS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-10-13 EP disclosed
WO-2003057205-A2 COMBINATION OF MTP INHIBITORS OR APOB SECRETION INHIBITORS WITH FIBRATES FOR USE AS DRUGS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-07-17 WO disclosed
WO-2003004020-A1 HETEROARYL CARBOXYLIC ACID AMIDES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS INHIBITORS OF THE MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN (MTP) BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-01-16 WO disclosed